Vitas-M small molecule compound

7-{2,3-bis[(2-chloro-6-fluorobenzyl)oxy]propyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK526515
SMILES Fc1cccc(c1COC(Cn1cnc2c1c(=O)n(C)c(=O)n2C)COCc1c(F)cccc1Cl)Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C24H22Cl2F2N4O4 MW 539.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22Cl2F2N4O4/c1-30-22-21(23(33)31(2)24(30)34)32(13-29-22)9-14(36-12-16-18(26)6-4-8-20(16)28)10-35-11-15-17(25)5-3-7-19(15)27/h3-8,13-14H,9-12H2,1-2H3
InChIKey
RTZBOIBWMZZHCG-UHFFFAOYSA-N
Synonyms
359712-78-0
359712780
7(23bis((2chloro6fluorobenzyl)oxy)propyl)13dimethyl1Hpurine26(3H7H)dione
7(23bis((2chloro6fluorobenzyl)oxy)propyl)13dimethyl37dihydro1Hpurine26dione
7(23BIS((2CHLORO6FLUOROPHENYL)METHOXY)PROPYL)13DIMETHYLPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(COCC3=C(C=CC=C3Cl)F)OCC4=C(C=CC=C4Cl)F
InChI=1SC24H22Cl2F2N4O4c1302221(23(33)31(2)24(30)34)32(132922)914(36121618(26)64820(16)28)1035111517(25)53719(15)27h381314H912H212H3
MFCD01943860
ZINC000097949803
ZINC000097949804

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Available files

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